rcdklibs: The CDK Libraries Packaged for R

An R interface to the Chemistry Development Kit, a Java library for chemoinformatics. Given the size of the library itself, this package is not expected to change very frequently. To make use of the CDK within R, it is suggested that you use the rcdk package. Note that it is possible to directly interact with the CDK using rJava. However rcdk exposes functionality in a more idiomatic way. The CDK library itself is released as LGPL and the sources can be obtained from https://github.com/cdk/cdk.

AuthorRajarshi Guha [aut], Zachary Charlop-Powers [cre], CDK Project [ctb, cph] (CDK Java library contained in multiple jar files)
Date of publication2016-05-16 14:32:33
MaintainerZachary Charlop-Powers <zach.charlop.powers@gmail.com>
LicenseLGPL
Version1.5.13

View on CRAN

Files in this package

rcdklibs
rcdklibs/inst
rcdklibs/inst/AUTHORS
rcdklibs/inst/cont
rcdklibs/inst/cont/cdk-1.5.13.jar
rcdklibs/NAMESPACE
rcdklibs/NEWS
rcdklibs/R
rcdklibs/R/rcdklibs.R
rcdklibs/MD5
rcdklibs/java
rcdklibs/java/README
rcdklibs/DESCRIPTION
rcdklibs/man
rcdklibs/man/rcdklibs.Rd

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